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Information card for entry 7109445
Preview
Coordinates | 7109445.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C144 H126 Cl0 Cu6 F0 N12 O0 P6 S0 Se6 |
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Calculated formula | C144 H126 Cu6 N12 P6 Se6 |
SMILES | C12=C3P4(C(=C2CCCC1)c1[n](cccc1)[Cu]12[n]5ccccc5C5=C6CCCCC6=C6P5(c5ccccc5)=[Se]2[Cu]2([n]5c6cccc5)[n]5c(C6=C7CCCCC7=C7P6(c6ccccc6)=[Se]2[Cu]2([n]6c(C8=C9CCCCC9=C9c%10[n](cccc%10)[Cu]%10([n]%11c(C%12=C%13CCCCC%13=C%13P%12(c%12ccccc%12)=[Se]%10[Cu]%10([n]%12c%13cccc%12)[n]%12c(C%13=C%14CCCCC%14=C%14P%13(c%13ccccc%13)=[Se]%10[Cu]([n]%10c3cccc%10)([n]3c%14cccc3)[Se]=41)cccc%12)cccc%11)[Se]2=P89c1ccccc1)cccc6)[n]1c7cccc1)cccc5)c1ccccc1 |
Title of publication | Syntheses of CuI polymetallic assemblies from reaction of ligands bearing the 2,5-bis(2-pyridyl)phosphole fragment with CuII precursors |
Authors of publication | Mehdi El Sayed Moussa; Fabian Friess; Wenting Shen; Muriel Hissler; Regis Reau; Christophe Lescop |
Journal of publication | Chem.Commun. |
Year of publication | 2013 |
Journal volume | 49 |
Pages of publication | 6158 |
a | 17.136 ± 0.003 Å |
b | 33.131 ± 0.006 Å |
c | 17.782 ± 0.009 Å |
α | 90° |
β | 107.947 ± 0.009° |
γ | 90° |
Cell volume | 9604 ± 5 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 10 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.188 |
Residual factor for significantly intense reflections | 0.0768 |
Weighted residual factors for significantly intense reflections | 0.1595 |
Weighted residual factors for all reflections included in the refinement | 0.1834 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.782 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7109445.html
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